SCHEMBL27922265

SCHEMBL27922265

C[C](C)CCCC(=O)N1CCOCC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 2/20 0.67
▸ RAB9A P51151 3/20 0.61
▸ L3MBTL1 Q9Y468 2/20 0.61
▸ POLB P06746 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ TSHR P16473 2/20 0.53
▸ ATM Q13315 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ NPC1 O15118 2/20 0.48
▸ USP2 O75604 1/20 0.48
▸ FKBP1A P62942 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ALOX15 P16050 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9415751 0.86 GLA (0.67) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL19574225 0.84 ATM (0.75) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL7694058 0.84 GLA (0.65) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL19574088 0.82 ATM (0.72) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL20520314 0.82 GLA (0.64) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL253804 0.82 GLA (0.64) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL2947983 0.82 GLA (0.64) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL20780402 0.81 GLA (0.63) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL4245553 0.81 GLA (0.62) GLARAB9AL3MBTL1POLBLMNA
SCHEMBL2718359 0.81 L3MBTL1 (0.69) GLARAB9AL3MBTL1POLBLMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103068824-A Novel 3, 5-disubstituted-3H-imidazo [4,5-B ] pyridines and 3, 5-disubstituted-3H- [1,2,3] triazolo [4,5-B ] pyridine compounds as protein kinase modulators INDIAN INCOZEN THERAPEUTICS PVT LTD 2013-04-24 — — CN disclosed
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